[(E)-1-[diethyl(methyl)silyl]-5-(oxiran-2-yl)pent-1-enoxy]-diethyl-methylsilane

C17H36O2Si2 — CID 11110275

IUPAC[(E)-1-[diethyl(methyl)silyl]-5-(oxiran-2-yl)pent-1-enoxy]-diethyl-methylsilane
SMILESCC[Si](C)(CC)O/C(=C\CCCC1CO1)[Si](C)(CC)CC
InChIInChI=1S/C17H36O2Si2/c1-7-20(5,8-2)17(19-21(6,9-3)10-4)14-12-11-13-16-15-18-16/h14,16H,7-13,15H2,1-6H3/b17-14+
InChIKeyDLDHLPUPTJEHLN-SAPNQHFASA-N
MW328.65 g/mol
LogP5.73
Rot. Bonds11

About [(E)-1-[diethyl(methyl)silyl]-5-(oxiran-2-yl)pent-1-enoxy]-diethyl-methylsilane

[(E)-1-[diethyl(methyl)silyl]-5-(oxiran-2-yl)pent-1-enoxy]-diethyl-methylsilane (PubChem CID 11110275) has the molecular formula C17H36O2Si2 and a molecular weight of 328.65 g/mol. Its IUPAC name is [(E)-1-[diethyl(methyl)silyl]-5-(oxiran-2-yl)pent-1-enoxy]-diethyl-methylsilane.

Molecular Properties

Compound Name[(E)-1-[diethyl(methyl)silyl]-5-(oxiran-2-yl)pent-1-enoxy]-diethyl-methylsilane
PubChem CID11110275
Molecular FormulaC17H36O2Si2
Molecular Weight328.65 g/mol
Exact Mass328.23
IUPAC Name[(E)-1-[diethyl(methyl)silyl]-5-(oxiran-2-yl)pent-1-enoxy]-diethyl-methylsilane
SMILESCC[Si](C)(CC)O/C(=C\CCCC1CO1)[Si](C)(CC)CC
InChIInChI=1S/C17H36O2Si2/c1-7-20(5,8-2)17(19-21(6,9-3)10-4)14-12-11-13-16-15-18-16/h14,16H,7-13,15H2,1-6H3/b17-14+
InChIKeyDLDHLPUPTJEHLN-SAPNQHFASA-N
XLogP5.73
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.65
LogP ≤ 55.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

Tert-butyl-dimethyl-[4-(oxiran-2-yl)butoxy]silane;tert-butyl-hex-5-enoxy-dimethylsilane
CID 161708708
tert-butyl-dimethyl-[4-[(2S)-oxiran-2-yl]butoxy]silane;tert-butyl-hex-5-enoxy-dimethylsilane;methane
CID 162119398
dimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane
CID 10734226
[(2R)-1-[(2S)-oxiran-2-yl]pent-4-en-2-yl]oxy-tri(propan-2-yl)silane
CID 102052244

Frequently Asked Questions

What is the IUPAC name of [(E)-1-[diethyl(methyl)silyl]-5-(oxiran-2-yl)pent-1-enoxy]-diethyl-methylsilane?
The IUPAC name of [(E)-1-[diethyl(methyl)silyl]-5-(oxiran-2-yl)pent-1-enoxy]-diethyl-methylsilane (CID 11110275) is [(E)-1-[diethyl(methyl)silyl]-5-(oxiran-2-yl)pent-1-enoxy]-diethyl-methylsilane.
What is the SMILES notation for [(E)-1-[diethyl(methyl)silyl]-5-(oxiran-2-yl)pent-1-enoxy]-diethyl-methylsilane?
The canonical SMILES for [(E)-1-[diethyl(methyl)silyl]-5-(oxiran-2-yl)pent-1-enoxy]-diethyl-methylsilane is CC[Si](C)(CC)O/C(=C\CCCC1CO1)[Si](C)(CC)CC.
What is the InChIKey of [(E)-1-[diethyl(methyl)silyl]-5-(oxiran-2-yl)pent-1-enoxy]-diethyl-methylsilane?
The InChIKey is DLDHLPUPTJEHLN-SAPNQHFASA-N. The full InChI is InChI=1S/C17H36O2Si2/c1-7-20(5,8-2)17(19-21(6,9-3)10-4)14-12-11-13-16-15-18-16/h14,16H,7-13,15H2,1-6H3/b17-14+.
What are the key properties of [(E)-1-[diethyl(methyl)silyl]-5-(oxiran-2-yl)pent-1-enoxy]-diethyl-methylsilane?
[(E)-1-[diethyl(methyl)silyl]-5-(oxiran-2-yl)pent-1-enoxy]-diethyl-methylsilane has a molecular weight of 328.65 g/mol, XLogP of 5.73, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-1-[diethyl(methyl)silyl]-5-(oxiran-2-yl)pent-1-enoxy]-diethyl-methylsilane is sourced from PubChem (CID 11110275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).